Interaction of low energy electrons with formic acid monomer,dimer and trimer |
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Authors: | L Ziemczonek T Wróblewski |
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Institution: | (1) Institute of Physics, Pomeranian Academy, 76-200 Słupsk, Poland |
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Abstract: | Configurations of the formic acid monomer, dimer and trimer
are presented. We have calculated the total energies for these structures. We
have considered also the negatively charged clusters and discussed the
possible pathways of interaction of low energy electrons with monomers and
clusters. Calculations have been executed using 6-311G** and 6-311++G** basis
sets. The electron affinities of monomer and clusters are presented. Influence
of choice of the molecular basis set is also discussed.
Only such systematic studies allow to explain values observed experimentally,
for example in electron attachment experiments on formic acid 1]. |
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Keywords: | |
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